Vitas-M small molecule compound
1-[(2,4-dichlorobenzyl)sulfanyl]-4-(2-phenylethyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK543923
SMILES Clc1ccc(c(c1)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H22Cl2N4OS2 MW 541.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2N4OS2/c27-18-11-10-17(20(28)14-18)15-34-26-30-29-25-31(13-12-16-6-2-1-3-7-16)23(33)22-19-8-4-5-9-21(19)35-24(22)32(25)26/h1-3,6-7,10-11,14H,4-5,8-9,12-13,15H2InChIKey
MRPOSKTXOLZDDR-UHFFFAOYSA-NSynonyms
498538-04-81((24dichlorobenzyl)sulfanyl)4(2phenylethyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((24dichlorobenzyl)thio)4phenethyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
498538048
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=C(C=C(C=C5)Cl)Cl)N(C3=O)CCC6=CC=CC=C6
InChI=1SC26H22Cl2N4OS2c2718111017(20(28)1418)15342630292531(1312166213716)23(33)2219845921(19)3524(22)32(25)26h1367101114H4589121315H2
MFCD03301862
ZINC000001813513
ZINC01813513
ZINC1813513
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